12-Methyltridec-2-enal

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C14H26O

    SMILES
    CC(C)CCCCCCCCC=CC=O

  • Odor profile

    Fatty 77.26%
    Citrus 72.89%
    Waxy 69.73%
    Aldehydic 63.23%
    Green 60.16%
    Fruity 56.49%
    Orange 52.58%
    Fresh 48.26%
    Floral 44.69%
    Sweet 42.83%

    Scent© AI

  • Properties

    XLogP3-AA
    5.6

    Molecular weight
    210.36 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    289°C

    Flash point est.
    125.26 ˚C

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1709.75
    methanol 820.98
    isopropanol 2001.16
    water 0.01
    ethyl acetate 2350.34
    n-propanol 1638.3
    acetone 2657.26
    n-butanol 1819.23
    acetonitrile 792.65
    DMF 1042.54
    toluene 841.0
    isobutanol 1330.73
    1,4-dioxane 2045.07
    methyl acetate 1148.16
    THF 5018.1
    2-butanone 2533.01
    n-pentanol 1271.42
    sec-butanol 1697.18
    n-hexane 1131.86
    ethylene glycol 43.83
    NMP 828.43
    cyclohexane 1330.21
    DMSO 1540.27
    n-butyl acetate 2329.28
    n-octanol 415.26
    chloroform 2491.95
    n-propyl acetate 1821.17
    acetic acid 412.4
    dichloromethane 2602.38
    cyclohexanone 2919.83
    propylene glycol 183.87
    isopropyl acetate 1726.03
    DMAc 802.14
    2-ethoxyethanol 1067.63
    isopentanol 1727.68
    n-heptane 563.3
    ethyl formate 640.75
    1,2-dichloroethane 2422.74
    n-hexanol 1506.46
    2-methoxyethanol 1394.29
    isobutyl acetate 1091.08
    tetrachloromethane 578.29
    n-pentyl acetate 1045.56
    transcutol 3836.4
    n-heptanol 496.48
    ethylbenzene 471.96
    MIBK 1595.05
    2-propoxyethanol 1714.58
    tert-butanol 2374.36
    MTBE 3253.17
    2-butoxyethanol 824.29
    propionic acid 539.04
    o-xylene 451.78
    formic acid 44.38
    diethyl ether 3891.98
    m-xylene 578.23
    p-xylene 539.18
    chlorobenzene 849.4
    dimethyl carbonate 181.68
    n-octane 144.39
    formamide 93.16
    cyclopentanone 2359.31
    2-pentanone 2936.29
    anisole 729.77
    cyclopentyl methyl ether 2774.09
    gamma-butyrolactone 1678.24
    1-methoxy-2-propanol 1591.09
    pyridine 1528.07
    3-pentanone 1446.62
    furfural 993.9
    n-dodecane 57.74
    diethylene glycol 513.7
    diisopropyl ether 1158.89
    tert-amyl alcohol 1697.43
    acetylacetone 1538.44
    n-hexadecane 69.8
    acetophenone 599.23
    methyl propionate 1148.39
    isopentyl acetate 2016.66
    trichloroethylene 2865.88
    n-nonanol 380.61
    cyclohexanol 1699.29
    benzyl alcohol 483.92
    2-ethylhexanol 1074.43
    isooctanol 494.7
    dipropyl ether 2471.68
    1,2-dichlorobenzene 749.25
    ethyl lactate 363.17
    propylene carbonate 941.92
    n-methylformamide 406.31
    2-pentanol 1677.61
    n-pentane 684.42
    1-propoxy-2-propanol 1805.0
    1-methoxy-2-propyl acetate 1549.81
    2-(2-methoxypropoxy) propanol 609.06
    mesitylene 423.57
    ε-caprolactone 1862.35
    p-cymene 350.79
    epichlorohydrin 2730.06
    1,1,1-trichloroethane 2223.29
    2-aminoethanol 232.35
    morpholine-4-carbaldehyde 1069.68
    sulfolane 1759.45
    2,2,4-trimethylpentane 217.12
    2-methyltetrahydrofuran 3990.45
    n-hexyl acetate 1156.55
    isooctane 213.47
    2-(2-butoxyethoxy)ethanol 966.39
    sec-butyl acetate 1321.83
    tert-butyl acetate 1775.43
    decalin 336.24
    glycerin 161.92
    diglyme 1806.85
    acrylic acid 238.49
    isopropyl myristate 415.81
    n-butyric acid 1573.3
    acetyl acetate 710.22
    di(2-ethylhexyl) phthalate 241.0
    ethyl propionate 1335.4
    nitromethane 701.42
    1,2-diethoxyethane 2457.08
    benzonitrile 635.44
    trioctyl phosphate 209.23
    1-bromopropane 2620.83
    gamma-valerolactone 2310.44
    n-decanol 267.35
    triethyl phosphate 392.78
    4-methyl-2-pentanol 854.53
    propionitrile 1050.59
    vinylene carbonate 595.95
    1,1,2-trichlorotrifluoroethane 986.04
    DMS 460.73
    cumene 321.66
    2-octanol 367.73
    2-hexanone 1991.53
    octyl acetate 441.89
    limonene 759.06
    1,2-dimethoxyethane 2228.27
    ethyl orthosilicate 454.85
    tributyl phosphate 292.94
    diacetone alcohol 1376.76
    N,N-dimethylaniline 438.43
    acrylonitrile 699.21
    aniline 712.62
    1,3-propanediol 537.61
    bromobenzene 1015.84
    dibromomethane 2247.79
    1,1,2,2-tetrachloroethane 2535.6
    2-methyl-cyclohexyl acetate 880.48
    tetrabutyl urea 345.59
    diisobutyl methanol 683.27
    2-phenylethanol 614.76
    styrene 584.47
    dioctyl adipate 503.58
    dimethyl sulfate 256.75
    ethyl butyrate 1592.87
    methyl lactate 276.34
    butyl lactate 564.09
    diethyl carbonate 664.8
    propanediol butyl ether 511.36
    triethyl orthoformate 941.15
    p-tert-butyltoluene 353.56
    methyl 4-tert-butylbenzoate 497.44
    morpholine 3185.05
    tert-butylamine 1769.64
    n-dodecanol 200.8
    dimethoxymethane 1198.45
    ethylene carbonate 631.69
    cyrene 418.04
    2-ethoxyethyl acetate 1051.04
    2-ethylhexyl acetate 1554.61
    1,2,4-trichlorobenzene 763.66
    4-methylpyridine 1583.93
    dibutyl ether 1474.86
    2,6-dimethyl-4-heptanol 683.27
    DEF 1667.6
    dimethyl isosorbide 1082.8
    tetrachloroethylene 1506.16
    eugenol 413.59
    triacetin 669.49
    span 80 569.03
    1,4-butanediol 189.36
    1,1-dichloroethane 2860.14
    2-methyl-1-pentanol 1073.34
    methyl formate 218.77
    2-methyl-1-butanol 1374.2
    n-decane 134.95
    butyronitrile 1712.69
    3,7-dimethyl-1-octanol 599.93
    1-chlorooctane 506.82
    1-chlorotetradecane 157.24
    n-nonane 161.71
    undecane 83.31
    tert-butylcyclohexane 310.37
    cyclooctane 362.87
    cyclopentanol 1292.62
    tetrahydropyran 4623.14
    tert-amyl methyl ether 1799.78
    2,5,8-trioxanonane 986.95
    1-hexene 2484.05
    2-isopropoxyethanol 952.58
    2,2,2-trifluoroethanol 79.84
    methyl butyrate 1754.79

    Scent© AI

1 3

IFRA standard 51

Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
 No restriction
Category 2
Products applied to the axillae
 No restriction Category 7B
Leave-on products applied to the hair with some hand contact
 No restriction
Category 3
Products applied to the face/body using fingertips
 No restriction Category 8
Products with significant anogenital exposure
 No restriction
Category 4
Products related to fine fragrance
 No restriction Category 9
Products with body and hand exposure, primarily rinse off
 No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 No restriction Category 10A
Household care products with mostly hand contact
 No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 No restriction
Category 5D
Baby Creams, baby Oils and baby talc
 No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 No restriction
Category 6
Products with oral and lip exposure
 No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction

Botanical

Name CAS Botanical Proportion
Cilantro (Coriander leaf) 3 8008-52-4 Coriandrum sativum L., fam. Apiaceae (Umbelliferae) 0.2%